使用说明vasp-skills 内容agents文件夹openai.yaml0.2 kBassets文件夹templates文件夹INCAR_bands.txt0.1 kBINCAR_relax.txt0.1 kBINCAR_static.txt0.1 kBKPOINTS_gamma.txt0.0 kBKPOINTS_mp_6x6x6.txt0.0 kBPOSCAR_si.txt0.1 kBvasp-standard-slurm.sh0.4 kBreferences文件夹cluster-execution-playbook.md3.0 kBdos-and-band-workflows.md1.1 kBerror-pattern-dictionary.md3.8 kBerror-recovery.md1.0 kBincar-tag-matrix.md1.5 kBinput-set-manual.md0.9 kBposcar-species-and-structure.md1.2 kBpseudopotential-kpoints-and-convergence.md1.2 kBrestarts-spin-and-wavefunction-files.md1.3 kBstage-and-parameter-matrix.md1.1 kBworkflow-handoff-matrix.md1.2 kBskill-card.md2.8 kBSKILL.md2.5 kB手动下载zip · 14.7 kBopenai.yamltext/plain请选择文件